4,4'-Di-tert-butyldiphenylamine

C₂₀H₂₇NCAS 4627-22-9281.44 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₂₀H₂₇N
Molar mass: 281.44 g/mol
Exact mass: 281.2143 Da
logP: 6.03Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

4627-22-9

SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=CC=C(C=C2)C(C)(C)C

InChIKey

OPEKHRGERHDLRK-UHFFFAOYSA-N

InChI

InChI=1S/C20H27N/c1-19(2,3)15-7-11-17(12-8-15)21-18-13-9-16(10-14-18)20(4,5)6/h7-14,21H,1-6H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 4,4'-Di-tert-butyldiphenylamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(4-tert-Butyl-phenyl)-phenyl-amine4496-49-582 % similar 1,4-Di-tert-butylbenzene1012-72-267 % similar 4-tert-Butylphenylhydrazine hydrochloride128231-55-058 % similar 4,4′-Bis(1,1-dimethylethyl)-1,1′-biphenyl1625-91-857 % similar 4,4′-Bis(α,α-dimethylbenzyl)diphenylamine10081-67-154 % similar 4-tert-Butyltoluene98-51-152 % similar 4'-tert-Butylacetanilide20330-45-452 % similar 4,4'-Di-tert-butyldiphenylmethane19099-48-050 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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